sodium;hydride;5-nitro-2H-tetrazole

CH2N5NaO2 — CID 173097476

IUPACsodium;hydride;5-nitro-2H-tetrazole
SMILESO=[N+]([O-])c1nn[nH]n1.[H-].[Na+]
InChIInChI=1S/CHN5O2.Na.H/c7-6(8)1-2-4-5-3-1;;/h(H,2,3,4,5);;/q;+1;-1
InChIKeyPEKNSFOVIJPYTF-UHFFFAOYSA-N
MW139.05 g/mol
LogP-3.78
Rot. Bonds1

About sodium;hydride;5-nitro-2H-tetrazole

sodium;hydride;5-nitro-2H-tetrazole (PubChem CID 173097476) has the molecular formula CH2N5NaO2 and a molecular weight of 139.05 g/mol. Its IUPAC name is sodium;hydride;5-nitro-2H-tetrazole.

Molecular Properties

Compound Namesodium;hydride;5-nitro-2H-tetrazole
PubChem CID173097476
Molecular FormulaCH2N5NaO2
Molecular Weight139.05 g/mol
Exact Mass139.01
IUPAC Namesodium;hydride;5-nitro-2H-tetrazole
SMILESO=[N+]([O-])c1nn[nH]n1.[H-].[Na+]
InChIInChI=1S/CHN5O2.Na.H/c7-6(8)1-2-4-5-3-1;;/h(H,2,3,4,5);;/q;+1;-1
InChIKeyPEKNSFOVIJPYTF-UHFFFAOYSA-N
XLogP-3.78
TPSA97.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.05
LogP ≤ 5-3.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-nitro-2H-tetrazole;hydroiodide
CID 159499881
1-methyltetrazole;5-nitro-2H-tetrazole
CID 146465693
sodium;3,5-dinitro-1H-1,2,4-triazole;hydride
CID 173200248
iron(3+);oxygen(2-);2H-tetrazol-5-amine;nitrate
CID 161287015
(E)-bis[5-nitro-2-(2H-tetrazol-5-yl)-1,2,4-triazol-3-yl]diazene
CID 139178749
CID 173309959
CID 173309959
5-[chloro(dinitro)methyl]-2H-tetrazole
CID 91987213
5-[difluoro(nitro)methyl]-2H-tetrazole
CID 2827682
N-nitro-2H-tetrazole-5-carboxamide
CID 170844684
sodium;hydride;2H-tetrazol-5-amine
CID 173196739
[(Z)-(4-nitrophenyl)methylideneamino]-(2H-tetrazol-5-yl)azanide
CID 135708218
(Z)-3-(4-nitrophenyl)-2-(2H-tetrazol-5-yl)prop-2-enenitrile
CID 132601605

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;5-nitro-2H-tetrazole?
The IUPAC name of sodium;hydride;5-nitro-2H-tetrazole (CID 173097476) is sodium;hydride;5-nitro-2H-tetrazole.
What is the SMILES notation for sodium;hydride;5-nitro-2H-tetrazole?
The canonical SMILES for sodium;hydride;5-nitro-2H-tetrazole is O=[N+]([O-])c1nn[nH]n1.[H-].[Na+].
What is the InChIKey of sodium;hydride;5-nitro-2H-tetrazole?
The InChIKey is PEKNSFOVIJPYTF-UHFFFAOYSA-N. The full InChI is InChI=1S/CHN5O2.Na.H/c7-6(8)1-2-4-5-3-1;;/h(H,2,3,4,5);;/q;+1;-1.
What are the key properties of sodium;hydride;5-nitro-2H-tetrazole?
sodium;hydride;5-nitro-2H-tetrazole has a molecular weight of 139.05 g/mol, XLogP of -3.78, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;5-nitro-2H-tetrazole is sourced from PubChem (CID 173097476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).